Geometry & MOs

Info

ID:	221706
PubChem CID:	85286060
Reduced:	N3O9C32H39 (1)
Stoich.:	A3B9C32D39 (1)
Weight, g/mol:	609.226371
ΔH_f, kcal/mol:	-334.46
Dipole, Da:	8.16
IP(EA), eV:	-8.87(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3,3-bis[4-(quinolin-2-ylmethoxy)phenyl]prop-2-enoxyimino]propanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C(C1=CC(=C(C(=C1)O)OC)O)NC(=O)C(CC(=O)NC(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)N

DOS

IR

Vibrations